4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine

C6H8FNS2 — CID 166774762

IUPAC4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine
SMILESCNc1csc(SC)c1F
InChIInChI=1S/C6H8FNS2/c1-8-4-3-10-6(9-2)5(4)7/h3,8H,1-2H3
InChIKeyZVZQTLQZCMZUMM-UHFFFAOYSA-N
MW177.27 g/mol
LogP2.65
Rot. Bonds2

About 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine

4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine (PubChem CID 166774762) has the molecular formula C6H8FNS2 and a molecular weight of 177.27 g/mol. Its IUPAC name is 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine.

Molecular Properties

Compound Name4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine
PubChem CID166774762
Molecular FormulaC6H8FNS2
Molecular Weight177.27 g/mol
Exact Mass177.01
IUPAC Name4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine
SMILESCNc1csc(SC)c1F
InChIInChI=1S/C6H8FNS2/c1-8-4-3-10-6(9-2)5(4)7/h3,8H,1-2H3
InChIKeyZVZQTLQZCMZUMM-UHFFFAOYSA-N
XLogP2.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine?
The IUPAC name of 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine (CID 166774762) is 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine.
What is the SMILES notation for 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine?
The canonical SMILES for 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine is CNc1csc(SC)c1F.
What is the InChIKey of 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine?
The InChIKey is ZVZQTLQZCMZUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FNS2/c1-8-4-3-10-6(9-2)5(4)7/h3,8H,1-2H3.
What are the key properties of 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine?
4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine has a molecular weight of 177.27 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-5-methylsulfanylthiophen-3-amine is sourced from PubChem (CID 166774762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).